2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K788-5303 |
| Compound Name: | 2-{2-[(3-chlorophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl}-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 521.01 |
| Molecular Formula: | C29 H29 Cl N2 O5 |
| Smiles: | CCOc1ccc(CCNC(CN2C(/C(=C\c3cccc(c3)[Cl])Oc3ccccc23)=O)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.3201 |
| logD: | 4.3201 |
| logSw: | -4.5661 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.766 |
| InChI Key: | WNHNAORSZNWRPR-UHFFFAOYSA-N |